Geometry & MOs

Info

ID:	77297
PubChem CID:	48426031
Reduced:	ON2C9H12 (2)
Stoich.:	AB2C9D12 (2)
Weight, g/mol:	356.221226
ΔH_f, kcal/mol:	-49.02
Dipole, Da:	2.91
IP(EA), eV:	-9.18(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(diethylamino)-2-oxoethyl]-3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)C1=C(N(N=C1C)C2=CC=CC=C2)C

DOS

IR

Vibrations